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Diisopropylammonium dichloroacetate structure, CAS 660-27-5

Diisopropylammonium dichloroacetate

CAS Number660-27-5

Synonyms2,2-dichloroacetic acid,N-propan-2-ylpropan-2-amine; Dichloroacetic acid - N-isopropyl-2-propanamine (1:1); Dichloroacetic acid - N-isopropylpropan-2-amine (1:1)

Molecular FormulaC8H17Cl2NO2

Molecular Weight230.132

Purity98.00%

Density

Boiling Point83.9ºC at 760 mmHg

Melting Point295ºC (dec.)(lit.)

Flash Point

Appearance

EINECS

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Cat. No.: 2A-9024787 Purity: 98.00%
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Quality Control of [ 660-27-5 ] Purity: 98.00% SDS Specification MoL

Chemical & Physical Properties
CAS Number660-27-5
Catalog No.2A-9024787
Chinese Name二异丙基胺二氯乙酸酯
Synonyms2,2-dichloroacetic acid,N-propan-2-ylpropan-2-amine; Dichloroacetic acid - N-isopropyl-2-propanamine (1:1); Dichloroacetic acid - N-isopropylpropan-2-amine (1:1)
Molecular FormulaC8H17Cl2NO2
Molecular Weight230.132
Purity98.00
Boiling Point83.9ºC at 760 mmHg
Melting Point295ºC (dec.)(lit.)
Storage ConditionRoom temperature, sealed, dry
ApplicationDiisopropylammonium dichloroacetate is a biochemical reagent that can be used as a biological material or organic compound for life science-related research.
HTC2921199090
SMILESCC(C)NC(C)C.O=C(O)C(Cl)Cl
InChIInChI=1S/C6H15N.C2H2Cl2O2/c1-5(2)7-6(3)4;3-1(4)2(5)6/h5-7H,1-4H3;1H,(H,5,6)
InChI KeyILKBHIBYKSHTKQ-UHFFFAOYSA-N
Use ofDiisopropylammonium dichloroacetate is a biochemical reagent that can be used as a biological material or organic compound for life science related research. Properties Name Diisopropylamine 2,2-dichloroacetate Synonym More Synonyms Diisopropylammonium dichloroacetate Biological Activity Description Diisopropylammonium dichloroacetate is a biochemical reagent that can be used as a biological material or organic compound for life science related research. Related Catalog Research Areas >> Others Chemical & Physical Properties Exact Mass 229.063629 PSA 49.33000 LogP 2.65840 InChIKey ILKBHIBYKSHTKQ-UHFFFAOYSA-N SMILES CC(C)NC(C)C.O=C(O)C(Cl)Cl Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CAS REGISTRY NUMBER : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C6-H15-N.C2-H2-Cl2-O2 MOLECULAR WEIGHT : WISWESSER LINE NOTATION : 1Y&MY &621 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - cyanosis Lungs, Thorax, or Respiration - other changes TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Behavioral - somnolence (general depressed activity) Behavioral - tremor Behavioral - convulsions or effect on seizure threshold TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - cyanosis Lungs, Thorax, or Respiration - other changes TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - cyanosis Lungs, Thorax, or Respiration - other changes TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intramuscular SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value MUTATION DATA TYPE OF TEST : Mutation in microorganisms TEST SYSTEM : Bacteria - Salmonella typhimurium DOSE/DURATION : 10 ug/plate REFERENCE : NUCADQ Nutrition and Cancer. (Franklin Institute Press, POB 2266, Phildelphia, PA 19103) V.1- 1978- Volume(issue)/page/year: 3,129,1982 Safety Information Hazard Codes Xi RIDADR UN 1789 8 HS Code 2921199090
Tax Rebate9.0%
Supervisionnone
Transport InfoProduct name: Summary 2921199090 other acyclic monoamines and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
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